| SpectraBase Spectrum ID |
IcroXGeWByH |
| Name |
Benzoic acid, 4-[[1-oxo-3-(4-phenyl-1-piperazinyl)propyl]amino]-, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.189591674 u |
| Formula |
C21H25N3O3 |
| InChI |
InChI=1S/C21H25N3O3/c1-27-21(26)17-7-9-18(10-8-17)22-20(25)11-12-23-13-15-24(16-14-23)19-5-3-2-4-6-19/h2-10H,11-16H2,1H3,(H,22,25) |
| InChIKey |
NZSVTFGDGVTNKF-UHFFFAOYSA-N |
| Molecular Weight |
367.449 g/mol |
| SMILES |
C1=CC=C(N2CCN(CCC(NC=3C=CC(C(=O)OC)=CC3)=O)CC2)C=C1 |
![Benzoic acid, 4-[[1-oxo-3-(4-phenyl-1-piperazinyl)propyl]amino]-, methyl ester](/api/spectrum/IcroXGeWByH/structure.png?h=300&w=458 "Benzoic acid, 4-[[1-oxo-3-(4-phenyl-1-piperazinyl)propyl]amino]-, methyl ester")
